COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: BBL008137
Chemical Name: (3,4,5-trimethoxybenzylidene)propanedinitrile
Smiles: COc1cc(C=C(C#N)C#N)cc(c1OC)OC

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Molecular Weight: 244.25
Empirical Formula: C13H12N2O3

Available Amount: 0 mg

Lipinsky:
logP: 1.563
Rotatable bonds: 2
H-donors: 0
H-acceptors: 3
PSA: 75
Number of rings: 1

     

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